N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C22H14BrN5OS MolecularWeight: 476.34846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br

InChI

InChI=1S/C22H14BrN5OS/c23-15-8-9-18-19(11-15)30-22(25-18)26-21(29)17-13-28(16-6-2-1-3-7-16)27-20(17)14-5-4-10-24-12-14/h1-13H,(H,25,26,29)